SCHEMBL7181767

SCHEMBL7181767

COC(=O)C1CCCCN1Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
LTA4H P09960 2/20 0.59
FKBP1A P62942 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
POLB P06746 1/20 0.55
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
CNR2 P34972 1/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6540812 1.00 MEN1 (0.60) MEN1KMT2ALTA4HFKBP1ASMN1; SMN2
SCHEMBL19465330 0.96 LTA4H (0.63) MEN1KMT2ALTA4HFKBP1ASMN1; SMN2
SCHEMBL952722 0.96 LTA4H (0.63) MEN1KMT2ALTA4HFKBP1ASMN1; SMN2
SCHEMBL952721 0.96 LTA4H (0.63) MEN1KMT2ALTA4HFKBP1ASMN1; SMN2
SCHEMBL2768950 0.90 FKBP1A (0.54) MEN1KMT2ALTA4HFKBP1APOLB
SCHEMBL1627052 0.86 MEN1 (0.77) MEN1KMT2AFKBP1ASMN1; SMN2POLB
SCHEMBL13804314 0.84 CNR2 (0.57) MEN1KMT2ASMN1; SMN2POLBKDM4E
SCHEMBL14598759 0.84 CNR2 (0.57) MEN1KMT2ASMN1; SMN2POLBKDM4E
SCHEMBL14828717 0.84 CNR2 (0.57) MEN1KMT2ASMN1; SMN2POLBKDM4E
SCHEMBL3713831 0.84 SMN1; SMN2 (0.63) MEN1KMT2ASMN1; SMN2CNR2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1294700-A2 BENZHYDRYL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-26 EP disclosed
WO-2003001914-A1 PARTICLE COMPRISING A MATRIX AND AT LEAST ONE BIOACTIVE AGENT RHODIANYL (FR) 2003-01-09 WO disclosed
WO-2002000631-A2 BENZHYDRYL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 WO disclosed
JP-2000136183-A PRODUCTION OF N-BENZYL-4-FORMYLPIPERIDINE EISAI CO LTD 2000-05-16 JP disclosed